File name: Pandora32s1_GreenbeltMD_20240630_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240701T051752.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240630_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20240630 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240630T125643.6Z 8947.539394 268 1 35.27 2 55.62 86.67 27.36 198.75 0.00 1 0.00 1 0 17 1.040e-02 5.784e-03 4.282e-03 1.850e-03 2.454241e-01 9.527356e-04 2.895172e-03 -6.000000e+00 6.051445e-03 232.74 -2.00 3.47 -2.00 316.52 0.00e+00 5.780935e-04 1.136507e-04 5.675824e-05 -6.000000e+00 2.685495e-04 288.89 -2.00 20.00 -2.00 315.71 0.00e+00 1.766 0.000 302.00 328.00 3 4.8228e+00 2.5082e-03 2.1751e-02 -6.0000e+00 1.5191e-02 3.8004e-03 2.7965e-03 1.2726e-02 -6.0000e+00 1.6392e-02 -2.4481e-03 1.6221e-03 6.1448e-03 -6.0000e+00 9.7636e-03 -2.7445e-03 7.6537e-04 1.7152e-03 -6.0000e+00 4.1495e-03 5.4915e-04 7.6598e-06 5.2201e-05 1.9266e-05 -6.0000e+00 2.7722e-04 6.8064e-03 2.3297e-05 12 1 1 12 1 1 96.82 22.74 0.27 0.00681 0.00686 14 5 1 5 0 2350.860 27.05 20.01 22.74 32.91 4.7 1053.68 2751 -1981 -1537 -2702 -5173 -1925 -293 975 89 -314 -3310 -2054 1274 -133 709 847 -797 1054 1456 2333 639 735 1898 486 571 -377 821 -943 -150 -1802 632 -361 474 218 -2805 -1071 -2781 -1077 -1083 76 -697 -870 344 -400 -47 489 -394 -59 -597 -217 -71 731 510 986 849 876 755 80 7 439 1013 1125 1205 1539 600 -523 -460 -222 582 522 37 346 -323 630 156 -344 -785 -1347 -869 -1074 -1456 -850 -1637 -1533 -521 -437 45 495 522 608 253 815 -314 -72 527 234 173 604 562 -351 -371 -793 -660 46 -869 -970 -623 -490 -12 521 393 496 242 323 66 69 102 108 -3 -7 -422 150 409 442 101 129 44 735 159 144 304 -302 -294 108 209 20 68 -17 80 55 54 -337 -777 413 -345 -278 -479 -850 -285 -44 158 16 -61 -661 -404 262 -31 185 242 -242 324 462 756 216 248 634 170 210 -145 315 -354 -53 -623 220 -135 187 90 -1148 -414 -1131 -482 -557 44 -437 -569 228 -270 -32 328 -264 -39 -387 -139 -47 503 367 732 648 678 594 63 5 340 794 917 1038 1386 552 -466 -385 -180 480 465 36 344 -325 620 149 -309 -657 -1079 -698 -927 -1364 -848 -1721 -1661 -582 -511 54 613 650 747 299 912 -333 -74 547 258 203 753 734 -463 -474 -967 -772 54 -1074 -1251 -824 -664 -16 748 584 746 360 463 89 90 132 143 -5 -10 -619 219 589 623 139 172 57 936 210 199 433 -439 -431 161 322 33 110 -28 132 91 87 -534 -1213 SS 20240630T130725.0Z 8947.546817 275 1 47.62 2 53.55 88.29 28.06 204.03 0.00 1 0.00 1 0 17 1.272e-02 6.514e-03 4.489e-03 1.968e-03 2.349912e-01 1.012146e-03 2.766116e-03 -6.000000e+00 7.408353e-03 232.74 -2.00 3.47 -2.00 316.49 0.00e+00 5.287892e-04 1.200408e-04 7.854595e-05 -6.000000e+00 3.286081e-04 288.89 -2.00 20.00 -2.00 315.68 0.00e+00 1.679 0.000 302.00 328.00 3 5.3491e+00 2.6639e-03 2.0723e-02 -6.0000e+00 1.8597e-02 9.4867e-03 2.9700e-03 1.2158e-02 -6.0000e+00 2.0064e-02 -1.1548e-03 1.7212e-03 5.8718e-03 -6.0000e+00 1.1951e-02 -3.9741e-03 8.1048e-04 1.6323e-03 -6.0000e+00 5.0815e-03 3.5840e-04 4.0817e-04 5.5529e-05 1.8284e-05 -6.0000e+00 3.3916e-04 5.5379e-03 1.0422e-04 11 8 0 10 0 0 99.92 22.77 0.28 0.00554 0.00861 15 4 1 5 0 3174.160 27.05 20.00 22.77 33.32 4.6 1056.05 3110 -3407 -845 -1886 -3732 -3240 -29 1393 -883 -1367 -4163 -4711 1271 -1078 2155 450 591 871 489 3333 -896 214 1514 1328 1563 -171 2370 -888 -507 -1132 -23 -96 3472 -263 -3578 -1834 -3540 -1839 -1578 -235 -670 -733 491 -106 -192 230 -107 284 -908 46 -19 784 1089 1060 1170 636 752 -280 349 358 784 1654 1214 1617 187 -242 -358 -478 191 616 -42 114 -118 793 -150 -192 -1455 -1366 -1521 -1055 -1104 -1697 -1109 -2058 -484 -106 252 441 289 963 417 614 -431 207 534 -69 233 518 496 139 -519 -915 -928 -111 -851 -1026 -491 -381 202 555 304 403 581 125 8 158 383 123 171 -55 -52 115 456 226 244 4 -290 379 244 127 300 -314 -160 30 -16 -60 78 -309 356 17 93 -324 -583 477 -617 -155 -340 -619 -495 -4 228 -165 -273 -853 -962 264 -258 561 130 179 270 158 1080 -309 73 512 465 573 -66 905 -336 -180 -389 -8 -36 1337 -109 -1468 -710 -1440 -825 -815 -136 -423 -483 328 -72 -131 156 -72 187 -591 29 -13 540 781 789 893 495 593 -223 274 278 616 1347 1051 1465 173 -216 -300 -387 158 549 -40 113 -119 782 -144 -172 -1220 -1087 -1217 -905 -1030 -1699 -1163 -2237 -542 -124 306 549 362 1187 495 688 -456 210 551 -76 273 645 648 183 -665 -1114 -1084 -130 -1051 -1325 -650 -518 281 800 453 610 865 179 11 206 490 161 233 -78 -76 168 657 319 334 5 -374 481 321 174 425 -454 -234 44 -24 -95 126 -508 588 28 149 -512 -907 SS 20240630T134503.2Z 8947.572953 303 1 48.56 2 46.24 94.36 31.77 220.52 0.00 1 0.00 1 0 17 7.647e-03 5.680e-03 5.490e-04 3.275e-04 2.031978e-01 1.693488e-04 2.406275e-03 -6.000000e+00 4.452377e-03 232.74 -2.00 3.47 -2.00 315.50 0.00e+00 3.197699e-04 1.625198e-05 4.662247e-05 -6.000000e+00 1.975259e-04 288.90 -2.00 20.00 -2.00 314.77 0.00e+00 1.444 0.000 302.00 328.00 3 2.2248e+00 4.4067e-04 1.7843e-02 -6.0000e+00 1.1177e-02 4.4194e-03 4.8894e-04 1.0478e-02 -6.0000e+00 1.2059e-02 -1.2027e-03 2.7942e-04 5.0655e-03 -6.0000e+00 7.1830e-03 -3.2698e-03 1.2582e-04 1.3908e-03 -6.0000e+00 3.0537e-03 1.0890e-02 2.0637e-04 9.1191e-06 1.7113e-05 -6.0000e+00 2.0387e-04 5.7478e-03 7.1362e-05 10 0 0 10 0 0 99.99 22.93 0.28 0.00575 0.00730 496 116 1 5 0 97.890 27.15 20.00 22.93 34.31 4.7 1061.29 388 -387 -235 -1683 -2581 -1622 -961 612 530 -110 -1206 -1040 -66 -95 545 287 29 637 974 1052 1061 475 1209 979 541 253 -61 -660 -289 46 683 760 1077 -619 -2536 -2065 -2115 -1174 -383 -182 -666 -522 -544 -678 -176 -238 -527 -554 -695 -477 430 694 719 1036 709 860 908 244 487 493 967 1274 1507 1462 452 -169 -112 -371 470 687 205 334 136 253 88 -228 -666 -1103 -1015 -920 -1267 -1283 -1720 -1564 -667 -496 -87 267 335 486 315 498 -168 207 279 56 301 533 357 -228 -318 -669 -622 -40 -671 -1004 -577 -465 -20 432 411 366 309 310 57 235 124 180 106 99 -214 129 224 197 393 379 105 762 400 120 110 -139 -182 28 46 -50 29 213 82 -181 -151 -413 -602 94 -105 -66 -460 -685 -389 -231 161 145 -32 -357 -302 -20 -33 198 115 12 272 428 476 461 221 558 439 257 126 -31 -317 -137 21 308 366 518 -317 -1262 -964 -1030 -650 -236 -124 -479 -395 -423 -535 -138 -186 -406 -412 -501 -337 309 531 582 830 588 726 780 212 414 414 823 1145 1389 1371 435 -160 -102 -317 410 637 202 347 143 261 86 -213 -586 -947 -873 -824 -1219 -1299 -1793 -1705 -765 -585 -104 332 420 595 377 566 -181 209 288 60 341 638 461 -298 -394 -797 -726 -47 -822 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